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Details

Stereochemistry ABSOLUTE
Molecular Formula C17H23NO3
Molecular Weight 289.3694
Optical Activity ( - )
Defined Stereocenters 2 / 2
E/Z Centers 0
Charge 0

SHOW SMILES / InChI
Structure of MESEMBRINE

SMILES

COC1=CC=C(C=C1OC)[C@]23CCN(C)[C@H]2CC(=O)CC3

InChI

InChIKey=DAHIQPJTGIHDGO-IRXDYDNUSA-N
InChI=1S/C17H23NO3/c1-18-9-8-17(7-6-13(19)11-16(17)18)12-4-5-14(20-2)15(10-12)21-3/h4-5,10,16H,6-9,11H2,1-3H3/t16-,17-/m0/s1

HIDE SMILES / InChI

Molecular Formula C17H23NO3
Molecular Weight 289.3694
Charge 0
Count
Stereochemistry ABSOLUTE
Additional Stereochemistry No
Defined Stereocenters 2 / 2
E/Z Centers 0
Optical Activity UNSPECIFIED

Approval Year

Substance Class Chemical
Created
by admin
on Mon Mar 31 22:18:59 GMT 2025
Edited
by admin
on Mon Mar 31 22:18:59 GMT 2025
Record UNII
86E2ZU4ETY
Record Status Validated (UNII)
Record Version
  • Download
Name Type Language
(-)-MESEMBRANONE
Preferred Name English
MESEMBRINE
MI  
Common Name English
6H-INDOL-6-ONE, 3A-(3,4-DIMETHOXYPHENYL)OCTAHYDRO-1-METHYL-, (3AS-CIS)-
Systematic Name English
MESEMBRIN
Common Name English
6H-INDOL-6-ONE, 3A-(3,4-DIMETHOXYPHENYL)OCTAHYDRO-1-METHYL-, (3AS,7AS)-
Systematic Name English
MESEMBRINE, (-)-
Common Name English
(-)-MESEMBRINE
Common Name English
MESEMBRANONE
Common Name English
4.ALPHA.,9.ALPHA.-MESEMBRINE
Common Name English
MESEMBRINE [MI]
Common Name English
Code System Code Type Description
CAS
24880-43-1
Created by admin on Mon Mar 31 22:18:59 GMT 2025 , Edited by admin on Mon Mar 31 22:18:59 GMT 2025
PRIMARY
MERCK INDEX
m7246
Created by admin on Mon Mar 31 22:18:59 GMT 2025 , Edited by admin on Mon Mar 31 22:18:59 GMT 2025
PRIMARY Merck Index
PUBCHEM
394162
Created by admin on Mon Mar 31 22:18:59 GMT 2025 , Edited by admin on Mon Mar 31 22:18:59 GMT 2025
PRIMARY
EPA CompTox
DTXSID50947774
Created by admin on Mon Mar 31 22:18:59 GMT 2025 , Edited by admin on Mon Mar 31 22:18:59 GMT 2025
PRIMARY
FDA UNII
86E2ZU4ETY
Created by admin on Mon Mar 31 22:18:59 GMT 2025 , Edited by admin on Mon Mar 31 22:18:59 GMT 2025
PRIMARY
Related Record Type Details
ACTIVE MOIETY